COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.0.0
HETATM    1  C   UNL     1      -4.237  -0.102  -0.164  1.00  0.00           C  
HETATM    2  C   UNL     1      -3.833  -1.338   0.372  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.404  -1.668   0.405  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.981   0.491  -0.625  1.00  0.00           C  
HETATM    5  C   UNL     1      -4.789  -2.232   0.864  1.00  0.00           C  
HETATM    6  C   UNL     1      -6.124  -1.894   0.821  1.00  0.00           C  
HETATM    7  C   UNL     1      -6.521  -0.672   0.290  1.00  0.00           C  
HETATM    8  C   UNL     1      -5.590   0.220  -0.194  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.235   4.452  -0.671  1.00  0.00           C  
HETATM   10  C   UNL     1       8.283   1.460   0.420  1.00  0.00           C  
HETATM   11  C   UNL     1       2.833  -1.025  -0.179  1.00  0.00           C  
HETATM   12  C   UNL     1       2.107  -0.085   0.544  1.00  0.00           C  
HETATM   13  C   UNL     1       2.766   1.000   1.110  1.00  0.00           C  
HETATM   14  C   UNL     1       4.130   1.137   0.953  1.00  0.00           C  
HETATM   15  C   UNL     1       4.849   0.195   0.232  1.00  0.00           C  
HETATM   16  C   UNL     1       4.194  -0.890  -0.336  1.00  0.00           C  
HETATM   17  O   UNL     1       6.194   0.334   0.081  1.00  0.00           O  
HETATM   18  S   UNL     1       1.973  -2.387  -0.898  1.00  0.00           S  
HETATM   19  N   UNL     1       0.363  -1.995  -0.834  1.00  0.00           N  
HETATM   20  C   UNL     1      -0.056  -1.020  -0.089  1.00  0.00           C  
HETATM   21  N   UNL     1       0.729  -0.234   0.702  1.00  0.00           N  
HETATM   22  O   UNL     1       2.333  -2.414  -2.272  1.00  0.00           O  
HETATM   23  O   UNL     1       2.157  -3.490  -0.021  1.00  0.00           O  
HETATM   24  C   UNL     1      -1.502  -0.734  -0.101  1.00  0.00           C  
HETATM   25  N   UNL     1      -3.293   0.781  -0.649  1.00  0.00           N  
HETATM   26  F   UNL     1      -7.051  -2.754   1.295  1.00  0.00           F  
HETATM   27  C   UNL     1      -3.731   2.064  -1.204  1.00  0.00           C  
HETATM   28  C   UNL     1      -3.776   3.112  -0.091  1.00  0.00           C  
HETATM   29  O   UNL     1      -1.185   1.301  -1.065  1.00  0.00           O  
HETATM   30  O   UNL     1      -1.974  -2.844   0.911  1.00  0.00           O  
HETATM   31  C   UNL     1      -4.232   5.664   0.263  1.00  0.00           C  
HETATM   32  C   UNL     1      -5.557   5.027  -0.161  1.00  0.00           C  
HETATM   33  C   UNL     1       6.801   1.474   0.692  1.00  0.00           C  
HETATM   34  N   UNL     1       9.066   2.446   0.902  1.00  0.00           N  
HETATM   35  O   UNL     1       8.771   0.562  -0.233  1.00  0.00           O  
HETATM   36  H   UNL     1      -4.483  -3.183   1.276  1.00  0.00           H  
HETATM   37  H   UNL     1      -7.571  -0.418   0.260  1.00  0.00           H  
HETATM   38  H   UNL     1      -5.911   1.167  -0.604  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.982   4.623  -1.717  1.00  0.00           H  
HETATM   40  H   UNL     1       2.210   1.736   1.671  1.00  0.00           H  
HETATM   41  H   UNL     1       4.640   1.981   1.394  1.00  0.00           H  
HETATM   42  H   UNL     1       4.751  -1.625  -0.897  1.00  0.00           H  
HETATM   43  H   UNL     1       0.302   0.251   1.425  1.00  0.00           H  
HETATM   44  H   UNL     1      -3.032   2.383  -1.977  1.00  0.00           H  
HETATM   45  H   UNL     1      -4.725   1.951  -1.638  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.782   3.225   0.342  1.00  0.00           H  
HETATM   47  H   UNL     1      -4.475   2.793   0.682  1.00  0.00           H  
HETATM   48  H   UNL     1      -1.012  -2.925   0.956  1.00  0.00           H  
HETATM   49  H   UNL     1      -3.905   5.507   1.291  1.00  0.00           H  
HETATM   50  H   UNL     1      -3.978   6.632  -0.169  1.00  0.00           H  
HETATM   51  H   UNL     1      -6.175   5.576  -0.872  1.00  0.00           H  
HETATM   52  H   UNL     1      -6.101   4.451   0.588  1.00  0.00           H  
HETATM   53  H   UNL     1       6.628   1.445   1.768  1.00  0.00           H  
HETATM   54  H   UNL     1       6.364   2.383   0.279  1.00  0.00           H  
HETATM   55  H   UNL     1      10.020   2.437   0.727  1.00  0.00           H  
HETATM   56  H   UNL     1       8.675   3.164   1.424  1.00  0.00           H  
CONECT    1    8    2    2   25                                       
CONECT    2    5    1    1    3                                       
CONECT    3    2   30   24   24                                       
CONECT    4   25   24   29   29                                       
CONECT    5    6    6    2   36                                       
CONECT    6   26    7    5    5                                       
CONECT    7    6    8    8   37                                       
CONECT    8    7    7    1   38                                       
CONECT    9   28   31   32   39                                       
CONECT   10   33   34   35   35                                       
CONECT   11   18   12   12   16                                       
CONECT   12   21   11   11   13                                       
CONECT   13   12   14   14   40                                       
CONECT   14   13   13   15   41                                       
CONECT   15   16   16   14   17                                       
CONECT   16   11   15   15   42                                       
CONECT   17   15   33                                                 
CONECT   18   19   22   22   11                                       
CONECT   18   23   23                                                 
CONECT   19   20   20   18                                            
CONECT   20   24   19   19   21                                       
CONECT   21   20   12   43                                            
CONECT   22   18   18                                                 
CONECT   23   18   18                                                 
CONECT   24    3    3    4   20                                       
CONECT   25    1   27    4                                            
CONECT   26    6                                                      
CONECT   27   28   25   44   45                                       
CONECT   28   27    9   46   47                                       
CONECT   29    4    4                                                 
CONECT   30    3   48                                                 
CONECT   31    9   32   49   50                                       
CONECT   32    9   31   51   52                                       
CONECT   33   17   10   53   54                                       
CONECT   34   10   55   56                                            
CONECT   35   10   10                                                 
CONECT   36    5                                                      
CONECT   37    7                                                      
CONECT   38    8                                                      
CONECT   39    9                                                      
CONECT   40   13                                                      
CONECT   41   14                                                      
CONECT   42   16                                                      
CONECT   43   21                                                      
CONECT   44   27                                                      
CONECT   45   27                                                      
CONECT   46   28                                                      
CONECT   47   28                                                      
CONECT   48   30                                                      
CONECT   49   31                                                      
CONECT   50   31                                                      
CONECT   51   32                                                      
CONECT   52   32                                                      
CONECT   53   33                                                      
CONECT   54   33                                                      
CONECT   55   34                                                      
CONECT   56   34                                                      
MASTER        0    0    0    0    0    0    0    0   56    0   56    0
END
